N-hexan-3-ylcyclopropanamine

C9H19N — CID 103920845

IUPACN-hexan-3-ylcyclopropanamine
SMILESCCCC(CC)NC1CC1
InChIInChI=1S/C9H19N/c1-3-5-8(4-2)10-9-6-7-9/h8-10H,3-7H2,1-2H3
InChIKeyNUPMWTYJXBFYQI-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.32
Rot. Bonds5

About N-hexan-3-ylcyclopropanamine

N-hexan-3-ylcyclopropanamine (PubChem CID 103920845) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-hexan-3-ylcyclopropanamine.

Molecular Properties

Compound NameN-hexan-3-ylcyclopropanamine
PubChem CID103920845
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-hexan-3-ylcyclopropanamine
SMILESCCCC(CC)NC1CC1
InChIInChI=1S/C9H19N/c1-3-5-8(4-2)10-9-6-7-9/h8-10H,3-7H2,1-2H3
InChIKeyNUPMWTYJXBFYQI-UHFFFAOYSA-N
XLogP2.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(cyclopropylamino)pentan-1-ol
CID 83815190
N-hexan-3-yl-3-methylsulfanylcyclopentan-1-amine
CID 115905990
1-N-hexan-3-ylcyclobutane-1,3-diamine
CID 80562320
N-heptan-4-yl-1-methylpiperidin-4-amine
CID 43373353
1-N,2-N-di(hexan-3-yl)cyclohexane-1,2-diamine
CID 67216091
1-N-hexan-3-ylcyclohexane-1,3-diamine
CID 79458783
N-heptan-4-yl-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 43672319
4-methyl-N-pentan-3-ylcycloheptan-1-amine
CID 65081260
1-methyl-N-octan-4-ylpiperidin-4-amine
CID 103776296
N-octan-4-yl-4-propylcyclohexan-1-amine
CID 114138056
N-heptan-4-yl-1,1-dioxothian-4-amine
CID 43615035
N-(1-phenylhexan-3-yl)cyclopropanamine
CID 115704621

Frequently Asked Questions

What is the IUPAC name of N-hexan-3-ylcyclopropanamine?
The IUPAC name of N-hexan-3-ylcyclopropanamine (CID 103920845) is N-hexan-3-ylcyclopropanamine.
What is the SMILES notation for N-hexan-3-ylcyclopropanamine?
The canonical SMILES for N-hexan-3-ylcyclopropanamine is CCCC(CC)NC1CC1.
What is the InChIKey of N-hexan-3-ylcyclopropanamine?
The InChIKey is NUPMWTYJXBFYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-3-5-8(4-2)10-9-6-7-9/h8-10H,3-7H2,1-2H3.
What are the key properties of N-hexan-3-ylcyclopropanamine?
N-hexan-3-ylcyclopropanamine has a molecular weight of 141.26 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexan-3-ylcyclopropanamine is sourced from PubChem (CID 103920845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).